N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(furan-2-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)-3,5-dinitrobenzamide
Chemical Structure Depiction of
N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(furan-2-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)-3,5-dinitrobenzamide
N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(furan-2-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)-3,5-dinitrobenzamide
Compound characteristics
| Compound ID: | V011-6476 |
| Compound Name: | N-(2-{[2-(3,4-dimethoxyphenyl)ethyl][(furan-2-yl)methyl]amino}-2-oxoethyl)-N-(2-methoxyethyl)-3,5-dinitrobenzamide |
| Molecular Weight: | 570.56 |
| Molecular Formula: | C27 H30 N4 O10 |
| Smiles: | COCCN(CC(N(CCc1ccc(c(c1)OC)OC)Cc1ccco1)=O)C(c1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5513 |
| logD: | 2.5513 |
| logSw: | -2.6983 |
| Hydrogen bond acceptors count: | 16 |
| Polar surface area: | 130.205 |
| InChI Key: | WITWXFOMLWZATF-UHFFFAOYSA-N |